3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)methyl]-5,7-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)methyl]-5,7-dimethyl-1H-quinolin-2-one Openeye Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-5,7-dimethyl-1H-quinolin-2-one CAS Name: 3-[(R)-1-azepan-1-iumyl-(1-cyclopentyl-5-tetrazolyl)methyl]-5,7-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-5,7-dimethyl-1H-quinolin-2-one Traditional Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-5,7-dimethyl-carbostyril Formula: C24H33N6O+ MolecularWeight: 421.55842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)C(C3=NN=NN3C4CCCC4)[NH+]5CCCCCC5)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)[C@H](C3=NN=NN3C4CCCC4)[NH+]5CCCCCC5)C

InChI

InChI=1S/C24H32N6O/c1-16-13-17(2)19-15-20(24(31)25-21(19)14-16)22(29-11-7-3-4-8-12-29)23-26-27-28-30(23)18-9-5-6-10-18/h13-15,18,22H,3-12H2,1-2H3,(H,25,31)/p+1/t22-/m1/s1